Geometry & MOs

Info

ID:	59452
PubChem CID:	24874905
Reduced:	O2N3H9C14 (1)
Stoich.:	A2B3C9D14 (1)
Weight, g/mol:	267.046633
ΔH_f, kcal/mol:	49.4
Dipole, Da:	8.54
IP(EA), eV:	-9.16(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-thiophen-2-yl-1H-pyrazolo[1,5-a]quinazolin-5-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N=C3N2NC(=C3)C4=CC=CO4

DOS

IR

Vibrations